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(5-Bromo-2-methoxyphenyl)(2-methyl-1-benzothiophen-3-yl)methanone
SpectraBase Compound ID CAcK2aNJRCK
InChI InChI=1S/C17H13BrO2S/c1-10-16(12-5-3-4-6-15(12)21-10)17(19)13-9-11(18)7-8-14(13)20-2/h3-9H,1-2H3
InChIKey KCJQCLMXCBTXNM-UHFFFAOYSA-N
Mol Weight 361.25 g/mol
Molecular Formula C17H13BrO2S
Exact Mass 359.981964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CA5rPuZljs
Name (5-Bromo-2-methoxyphenyl)(2-methyl-1-benzothiophen-3-yl)methanone
Alternate Name(s) (5-bromo-2-methoxyphenyl)(2-methylbenzo[b]thiophen-3-yl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13BrO2S
InChI InChI=1S/C17H13BrO2S/c1-10-16(12-5-3-4-6-15(12)21-10)17(19)13-9-11(18)7-8-14(13)20-2/h3-9H,1-2H3
InChIKey KCJQCLMXCBTXNM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbdv.201200275
Molecular Weight 361.253 g/mol
SMILES C(=O)(c1c(sc2c1cccc2)C)c1c(ccc(c1)Br)OC
SPLASH splash10-0ina-0987000000-2011d5ecf6644fd32024
Source of Spectrum CBD-9-2626-8e
Wiley ID 1771081